Chemical ID: 5884164

Cc1ccc(c(c1)C)n2c(cc(n2)C(C)(C)C)NC(=O)CN(C)C(=O)c3cccc(c3)Br
Chemical ID:
5884164
Name [?]:
3-bromo-N-[[2-(2,4-dimethylphenyl)-5-tert-butyl-pyrazol-3-yl]carbamoylmethyl]-N-methyl-benzamide
SMILES [?]:
Cc1ccc(c(c1)C)n2c(cc(n2)C(C)(C)C)NC(=O)CN(C)C(=O)c3cccc(c3)Br
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C25H29BrN4O2
All Atoms:32
Heavy Atoms:32
Chiral Atoms:0
ZAP Information [?]
Total:13.486
Area:686.206
Solvation:-3.66915
Coulombic:-44.3877
Bond Count [?]
All:34
Single:24
Double:10
Rotors:8
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:497.428
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:5.29
LogP (Chemaxon):5.92

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue